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Re: [abinit-forum] want software


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  • From: "Tonatiuh Rangel" <Tonatiuh.Rangel@uclouvain.be>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] want software
  • Date: Tue, 19 Aug 2008 11:03:50 +0200 (CEST)
  • Importance: Normal

Dear Asa,

This variable prtwant was made for an old interface between ABINIT and WanT.
Now it does not work anymore because WanT has changed.

Now prtwant=2 is used to call Wannier90 at the end of a ground state
calculation.
You can also do transport calculations with the new version of Wannier90,
that is Wannier90-1.0.
But you have to wait for abinit 5.6 for the interface between ABINIT and
Wannier90-1.0

Best wishes,
Tonatiuh Rangel



> Hi friends,
> I have seen in the input variale list that we can use want software with
> abinit
> by using prtwant . I couldnt find any test or examples, which combine
> abinit
> with want.. Where can I get sufficient information regarding this. ??
> I would like to know the procedure of doing transport calculations using
> abinit
> and want...
> thanks in advance
> Asa
>





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